# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9DW' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy C0 C -1.17900 -2.53800 1.07800 1.000 C1 C -1.77300 -2.21500 -0.29400 1.000 C2 C -4.84900 -0.03900 0.00500 1.000 C3 C -2.92600 1.39200 -0.06200 1.000 C4 C -2.10200 0.27300 -0.16300 1.000 C5 C -0.63000 0.44000 -0.25300 1.000 C6 C 1.42600 1.28900 0.65100 1.000 C7 C 2.11600 0.75200 -0.42000 1.000 C8 C 1.43800 0.06500 -1.41100 1.000 C9 C 0.07000 -0.09400 -1.33300 1.000 C10 C 3.61000 0.92200 -0.51200 1.000 C11 C -2.66200 -1.00300 -0.18500 1.000 C12 C -4.03000 -1.15500 -0.10100 1.000 C13 C -4.29400 1.23300 0.02200 1.000 C14 C 0.05700 1.13700 0.74000 1.000 C15 C 4.30000 -0.24900 0.19100 1.000 C16 C 5.79100 -0.14500 -0.00500 1.000 C17 C -6.97900 0.99900 0.19500 1.000 N18 N 3.99200 -0.20800 1.62700 1.000 O19 O 6.48600 0.30600 0.87400 1.000 O20 O -6.19600 -0.19200 0.08800 1.000 H21 H -0.61900 -3.47100 1.02100 1.000 H22 H -0.51300 -1.73100 1.38400 1.000 H23 H -1.98300 -2.64100 1.80700 1.000 H24 H -0.96800 -2.01300 -1.00000 1.000 H25 H -2.35900 -3.06500 -0.64500 1.000 H26 H -2.49500 2.38200 -0.04900 1.000 H27 H 1.95900 1.82800 1.42000 1.000 H28 H 1.98200 -0.35200 -2.24600 1.000 H29 H -0.45800 -0.63100 -2.10700 1.000 H30 H 3.91000 0.94400 -1.55900 1.000 H31 H 3.90000 1.85600 -0.03100 1.000 H32 H -4.46500 -2.14400 -0.11700 1.000 H33 H -4.93400 2.10000 0.10000 1.000 H34 H -0.48100 1.55700 1.57700 1.000 H35 H 3.94300 -1.18800 -0.23100 1.000 H36 H -6.69100 1.54300 1.09400 1.000 H37 H -6.80900 1.62600 -0.68000 1.000 H38 H -8.03500 0.73500 0.25300 1.000 H39 H 4.31300 0.65300 2.04200 1.000 H40 H 3.00500 -0.34100 1.78800 1.000 O41 O 6.34600 -0.55300 -1.15700 1.000 H42 H 7.30600 -0.46600 -1.23700 1.000